UCSF

ZINC36155970

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 35 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Hi High (pH 8-9.5) 4.10 10.88 -12.22 3 6 0 75 488.657 7
Hi High (pH 8-9.5) 4.10 10.93 -13.08 3 6 0 75 488.657 7

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )